J099-1054 Screening compound: 5-{[4-(2,3-dimethylphenyl)piperazino]carbonyl}-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinolin-6-one

J099-1054 Screening compound: 5-{[4-(2,3-dimethylphenyl)piperazino]carbonyl}-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinolin-6-one
J099-1054 Screening compound: 5-{[4-(2,3-dimethylphenyl)piperazino]carbonyl}-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinolin-6-one alternative view

Chemical Structure Depiction of ChemDiv screening compound J099-1054
5-{[4-(2,3-dimethylphenyl)piperazino]carbonyl}-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinolin-6-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

J099-1054

Molecular Formula

C24H25N3O2 (C24 H25 N3 O2)

Compound Name

5-{[4-(2,3-dimethylphenyl)piperazino]carbonyl}-1,2-dihydro-6H-pyrrolo[3,2,1-ij]quinolin-6-one

IUPAC name

10-[4-(23-dimethylphenyl)piperazine-1-carbonyl]-1-azatricyclo[6.3.1.0^{412}]dodeca-468(12)10-tetraen-9-one

SMILES

Cc1cccc(N(CC2)CCN2C(C2=CN(CCc3ccc4)c3c4C2=O)=O)c1C

InChI

InChI=1S/C24H25N3O2/c1-16-5-3-8-21(17(16)2)25-11-13-26(14-12-25)24(29)20-15-27-10-9-18-6-4-7-19(22(18)27)23(20)28/h3-8,15H,9-14H2,1-2H3

InChI Key

PBFAZPHSXHNVSC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15081148

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

387.48

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.689

Distribution Coefficient, logD

3.689

Water Solubility, LogSw

-4.02

Polar Surface Area

36.856

Acid Dissociation Constant (pKa)

26.03

Base Dissociation Constant (pKb)

2.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with J099-1054 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J099-1054?
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What is the minimum amount of J099-1054 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J099-1054
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J099-1054
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of J099-1054 available by request